2-acetamido-3-(1H-indol-3-yl)-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: 2-acetamido-3-(1H-indol-3-yl)-3-(phenylmethylsulfanyl)propanamide Openeye Name: 2-acetamido-3-benzylsulfanyl-3-(1H-indol-3-yl)propanamide CAS Name: 2-acetamido-3-(1H-indol-3-yl)-3-(phenylmethylthio)propanamide IUPAC Name: 2-acetamido-3-benzylsulfanyl-3-(1H-indol-3-yl)propanamide Traditional Name: 2-acetamido-3-(benzylthio)-3-(1H-indol-3-yl)propionamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(C1=CNC2=CC=CC=C21)SCC3=CC=CC=C3)C(=O)N

Isomeric SMILES

CC(=O)NC(C(C1=CNC2=CC=CC=C21)SCC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C20H21N3O2S/c1-13(24)23-18(20(21)25)19(26-12-14-7-3-2-4-8-14)16-11-22-17-10-6-5-9-15(16)17/h2-11,18-19,22H,12H2,1H3,(H2,21,25)(H,23,24)